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ChEBI
> Main
CHEBI:34316 - 3'-O-(4-Benzoyl)benzoyl ATP
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ChEBI Ontology
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ChEBI Name
3'-O-(4-Benzoyl)benzoyl ATP
ChEBI ID
CHEBI:34316
Stars
This entity has been manually annotated by a third party.
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Formula
C24H24N5O15P3
Net Charge
0
Average Mass
715.394
Monoisotopic Mass
715.04818
InChI
InChI=1S/C24H24N5O15P3/c25-
21-
17-
22(27-
11-
26-
21)
29(12-
28-
17)
23-
19(31)
20(16(41-
23)
10-
40-
46(36,37)
44-
47(38,39)
43-
45(33,34)
35)
42-
24(32)
15-
8-
6-
14(7-
9-
15)
18(30)
13-
4-
2-
1-
3-
5-
13/h1-
9,11-
12,16,19-
20,23,31H,10H2,(H,36,37)
(H,38,39)
(H2,25,26,27)
(H2,33,34,35)
/t16-
,19-
,20-
,23-
/m1/s1
InChIKey
AWJJLYZBWRIBCZ-UGTJMOTHSA-N
SMILES
Nc1ncnc2n(cnc12)
[C@@H]
1O[C@H]
(COP(O)
(=O)
OP(O)
(=O)
OP(O)
(O)
=O)
[C@@H]
(OC(=O)
c2ccc(cc2)
C(=O)
c2ccccc2)
[C@H]
1O
Roles Classification
Biological Role
(s):
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
(via
nucleoside 5'-triphoshate
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
3'-O-(4-Benzoyl)benzoyl ATP (
CHEBI:34316
)
is a
purine ribonucleoside triphosphate (
CHEBI:26398
)
Synonyms
Sources
3'-O-(4-Benzoyl)benzoyl ATP
KEGG COMPOUND
BzATP
KEGG COMPOUND
Manual Xref
Database
C13744
KEGG COMPOUND
View more database links
Registry Number
Type
Source
81790-82-1
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014